SCHEMBL28295643

SCHEMBL28295643

Brc1ccc(CNC(CCc2ccccc2)c2ccccc2)cc1

nearest known ligand 0.54

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.54
L3MBTL1 Q9Y468 3/20 0.44
ATM Q13315 1/20 0.44
SIGMAR1 Q99720 1/20 0.44
KMT2A Q03164 3/20 0.43
MEN1 O00255 2/20 0.43
NPSR1 Q6W5P4 1/20 0.43
BCHE P06276 1/20 0.43
HSP90AA1 P07900 1/20 0.43
CNR1 P21554 2/20 0.42
CNR2 P34972 2/20 0.42
ACP3 P15309 2/20 0.41
MAPT P10636 1/20 0.39
MMP8 P22894 1/20 0.39

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL7242928 0.90 SMN1; SMN2 (0.59) SMN1; SMN2L3MBTL1ATMSIGMAR1BCHE
SCHEMBL28295645 0.84 ATM (0.58) SMN1; SMN2L3MBTL1ATMKMT2AMEN1
SCHEMBL5265845 0.80 BCHE (0.69) KMT2AMEN1NPSR1BCHE
SCHEMBL323957 0.78 ADRB2 (0.56) SMN1; SMN2L3MBTL1ATMSIGMAR1KMT2A
SCHEMBL2191437 0.75 SMN1; SMN2 (0.57) SMN1; SMN2L3MBTL1ATMSIGMAR1KMT2A
SCHEMBL2602792 0.75 SMN1; SMN2 (0.57) SMN1; SMN2L3MBTL1ATMSIGMAR1NPSR1
SCHEMBL4890461 0.74 CNR2 (0.49) SMN1; SMN2L3MBTL1ATMKMT2AMEN1
SCHEMBL4885769 0.74 CNR2 (0.49) SMN1; SMN2L3MBTL1ATMKMT2AMEN1
SCHEMBL4885775 0.74 CNR2 (0.49) SMN1; SMN2L3MBTL1ATMKMT2AMEN1
SCHEMBL13041050 0.73 SMN1; SMN2 (0.70) SMN1; SMN2KMT2AMEN1NPSR1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-106749077-B A method of synthesis oxazoline compound 广西师范大学 2019-05-21 CN disclosed